N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide

C12H20N4O — CID 113433582

IUPACN-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide
SMILESCC(C)c1cc(NC(=O)CC2CCCN2)n[nH]1
InChIInChI=1S/C12H20N4O/c1-8(2)10-7-11(16-15-10)14-12(17)6-9-4-3-5-13-9/h7-9,13H,3-6H2,1-2H3,(H2,14,15,16,17)
InChIKeyBOUKQHXLVJLPTD-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.61
Rot. Bonds4

About N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide

N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide (PubChem CID 113433582) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide
PubChem CID113433582
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide
SMILESCC(C)c1cc(NC(=O)CC2CCCN2)n[nH]1
InChIInChI=1S/C12H20N4O/c1-8(2)10-7-11(16-15-10)14-12(17)6-9-4-3-5-13-9/h7-9,13H,3-6H2,1-2H3,(H2,14,15,16,17)
InChIKeyBOUKQHXLVJLPTD-UHFFFAOYSA-N
XLogP1.61
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclobutyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)acetamide
CID 103710671
N-(5-propyl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide
CID 104618156
N-(5-propan-2-yl-1H-pyrazol-3-yl)cyclooctanecarboxamide
CID 115663305
N-(3-propan-2-ylphenyl)-2-pyrrolidin-2-ylacetamide
CID 61372360
N-[4-fluoro-2-(propan-2-ylamino)phenyl]-2-pyrrolidin-2-ylacetamide
CID 119873541
N-(4-propan-2-yl-1,3-thiazol-2-yl)-2-pyrrolidin-2-ylacetamide
CID 54958427
N-(3-propan-2-yl-1-pyrimidin-2-ylpyrazol-5-yl)-2-pyrrolidin-2-ylacetamide
CID 119778033
3-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)butanamide
CID 104618436
N-(2,4-dimethyl-3-pyridinyl)-2-pyrrolidin-2-ylacetamide
CID 112741904
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119681127
2-methyl-N-[3-[(2-pyrrolidin-2-ylacetyl)amino]phenyl]propanamide
CID 61366011
N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide
CID 119752785

Frequently Asked Questions

What is the IUPAC name of N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide (CID 113433582) is N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide is CC(C)c1cc(NC(=O)CC2CCCN2)n[nH]1.
What is the InChIKey of N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide?
The InChIKey is BOUKQHXLVJLPTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-8(2)10-7-11(16-15-10)14-12(17)6-9-4-3-5-13-9/h7-9,13H,3-6H2,1-2H3,(H2,14,15,16,17).
What are the key properties of N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide?
N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide has a molecular weight of 236.32 g/mol, XLogP of 1.61, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 113433582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).